CID 15662088

1h,2h-pyrrolo[1,2-a]pyrazin-1-one

Structural Information

Molecular Formula
C7H6N2O
SMILES
C1=CN2C=CNC(=O)C2=C1
InChI
InChI=1S/C7H6N2O/c10-7-6-2-1-4-9(6)5-3-8-7/h1-5H,(H,8,10)
InChIKey
LFASPBCAVCUZES-UHFFFAOYSA-N
Compound name
2H-pyrrolo[1,2-a]pyrazin-1-one
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

2
References

279
Patents

134.04802 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 135.05530 121.3
[M+Na]+ 157.03724 132.9
[M-H]- 133.04074 122.8
[M+NH4]+ 152.08184 143.0
[M+K]+ 173.01118 129.4
[M+H-H2O]+ 117.04528 115.1
[M+HCOO]- 179.04622 145.0
[M+CH3COO]- 193.06187 136.2
[M+Na-2H]- 155.02269 131.0
[M]+ 134.04747 121.8
[M]- 134.04857 121.8
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe